N-(furan-2-ylmethyl)-1-(phenylsulfonyl)-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-(phenylsulfonyl)-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(2-furylmethyl)-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(2-furanylmethyl)-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(furan-2-ylmethyl)-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-besyl-N-(2-furfuryl)-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H20N2O4S MolecularWeight: 396.4595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)N(C1)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)N(C1)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O4S/c24-21(22-15-18-7-5-13-27-18)17-10-11-20-16(14-17)6-4-12-23(20)28(25,26)19-8-2-1-3-9-19/h1-3,5,7-11,13-14H,4,6,12,15H2,(H,22,24)